N'-(5-amino-6-cyclohexyloxypyrimidin-4-yl)pyridine-2-carbohydrazide

C16H20N6O2 — CID 19152018

IUPACN'-(5-amino-6-cyclohexyloxypyrimidin-4-yl)pyridine-2-carbohydrazide
SMILESNc1c(NNC(=O)c2ccccn2)ncnc1OC1CCCCC1
InChIInChI=1S/C16H20N6O2/c17-13-14(21-22-15(23)12-8-4-5-9-18-12)19-10-20-16(13)24-11-6-2-1-3-7-11/h4-5,8-11H,1-3,6-7,17H2,(H,22,23)(H,19,20,21)
InChIKeyCAIJSMPYCFAUJW-UHFFFAOYSA-N
MW328.38 g/mol
LogP1.92
Rot. Bonds5

About N'-(5-amino-6-cyclohexyloxypyrimidin-4-yl)pyridine-2-carbohydrazide

N'-(5-amino-6-cyclohexyloxypyrimidin-4-yl)pyridine-2-carbohydrazide (PubChem CID 19152018) has the molecular formula C16H20N6O2 and a molecular weight of 328.38 g/mol. Its IUPAC name is N'-(5-amino-6-cyclohexyloxypyrimidin-4-yl)pyridine-2-carbohydrazide.

Molecular Properties

Compound NameN'-(5-amino-6-cyclohexyloxypyrimidin-4-yl)pyridine-2-carbohydrazide
PubChem CID19152018
Molecular FormulaC16H20N6O2
Molecular Weight328.38 g/mol
Exact Mass328.16
IUPAC NameN'-(5-amino-6-cyclohexyloxypyrimidin-4-yl)pyridine-2-carbohydrazide
SMILESNc1c(NNC(=O)c2ccccn2)ncnc1OC1CCCCC1
InChIInChI=1S/C16H20N6O2/c17-13-14(21-22-15(23)12-8-4-5-9-18-12)19-10-20-16(13)24-11-6-2-1-3-7-11/h4-5,8-11H,1-3,6-7,17H2,(H,22,23)(H,19,20,21)
InChIKeyCAIJSMPYCFAUJW-UHFFFAOYSA-N
XLogP1.92
TPSA115.05 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.38
LogP ≤ 51.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-[5-amino-6-(propan-2-ylamino)pyrimidin-4-yl]pyridine-2-carbohydrazide
CID 19135675
4-N-[(2-chlorophenyl)methyl]-6-cyclohexyloxypyrimidine-4,5-diamine
CID 19154177
N'-[5-amino-6-(4-benzylpiperidin-1-yl)pyrimidin-4-yl]pyridine-2-carbohydrazide
CID 19139500
N'-[5-amino-6-(3-methylbutylamino)pyrimidin-4-yl]pyridine-2-carbohydrazide
CID 19151979
6-cyclohexyloxy-4-N-(3,4-dichlorophenyl)pyrimidine-4,5-diamine
CID 22546948
dimethyl 5-[(5-amino-6-cyclohexyloxypyrimidin-4-yl)amino]benzene-1,3-dicarboxylate
CID 22547754
4-N-(3-chloro-2-methylphenyl)-6-cyclohexyloxypyrimidine-4,5-diamine
CID 22545500
N'-[5-amino-6-[4-chloro-3-(trifluoromethyl)anilino]pyrimidin-4-yl]pyridine-2-carbohydrazide
CID 19151977
N'-[5-amino-6-(cycloheptylamino)pyrimidin-4-yl]-2-phenoxyacetohydrazide
CID 19152339
4-N-(1,3-benzothiazol-2-yl)-6-cyclohexyloxypyrimidine-4,5-diamine
CID 19146051
N'-[5-amino-6-(cyclohexylamino)pyrimidin-4-yl]-4-fluorobenzohydrazide
CID 19135857
N'-[5-amino-6-(cyclopentylamino)pyrimidin-4-yl]-3-chlorobenzohydrazide
CID 19151564

Frequently Asked Questions

What is the IUPAC name of N'-(5-amino-6-cyclohexyloxypyrimidin-4-yl)pyridine-2-carbohydrazide?
The IUPAC name of N'-(5-amino-6-cyclohexyloxypyrimidin-4-yl)pyridine-2-carbohydrazide (CID 19152018) is N'-(5-amino-6-cyclohexyloxypyrimidin-4-yl)pyridine-2-carbohydrazide.
What is the SMILES notation for N'-(5-amino-6-cyclohexyloxypyrimidin-4-yl)pyridine-2-carbohydrazide?
The canonical SMILES for N'-(5-amino-6-cyclohexyloxypyrimidin-4-yl)pyridine-2-carbohydrazide is Nc1c(NNC(=O)c2ccccn2)ncnc1OC1CCCCC1.
What is the InChIKey of N'-(5-amino-6-cyclohexyloxypyrimidin-4-yl)pyridine-2-carbohydrazide?
The InChIKey is CAIJSMPYCFAUJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6O2/c17-13-14(21-22-15(23)12-8-4-5-9-18-12)19-10-20-16(13)24-11-6-2-1-3-7-11/h4-5,8-11H,1-3,6-7,17H2,(H,22,23)(H,19,20,21).
What are the key properties of N'-(5-amino-6-cyclohexyloxypyrimidin-4-yl)pyridine-2-carbohydrazide?
N'-(5-amino-6-cyclohexyloxypyrimidin-4-yl)pyridine-2-carbohydrazide has a molecular weight of 328.38 g/mol, XLogP of 1.92, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(5-amino-6-cyclohexyloxypyrimidin-4-yl)pyridine-2-carbohydrazide is sourced from PubChem (CID 19152018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).